| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 28 | Yes |
Popular Name: N-[3-(4-thia-1,6-diazabicyclo[3.3.0]octa-5,7-dien-7-yl)phenyl]naphthalene-2-sulfonamide N-[3-(4-thia-1,6-diazabicyclo[3.…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.37 | -4.84 | -19.68 | 1 | 5 | 0 | 64 | 407.52 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.37 | -4.27 | -63.37 | 0 | 5 | -1 | 66 | 406.512 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.37 | -4.02 | -55.63 | 1 | 5 | 0 | 67 | 407.52 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.37 | -4.6 | -38.5 | 2 | 5 | 1 | 65 | 408.528 | 4 | ↓ |
